SCHEMBL22988097

SCHEMBL22988097

N#Cc1ccc(-c2nc3c4cccc(C(F)(F)F)c4nc(Cl)n3n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.40
NR1H2 P55055 10/20 0.38
NR1H3 Q13133 10/20 0.38
ADORA3 P0DMS8 4/20 0.37
EGLN2 Q96KS0 1/20 0.36
ADORA2A P29274 2/20 0.35
ADORA1 P30542 1/20 0.35
NR1I2 O75469 1/20 0.35
NR3C1 P04150 1/20 0.35
AR P10275 1/20 0.35
RXRA P19793 1/20 0.35
PSD A5PKW4 1/20 0.35
USP1 O94782 1/20 0.35
WDR48 Q8TAF3 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22987708 0.88 NR1H2 (0.48) NR1H2NR1H3ADORA3ADORA2AADORA1
SCHEMBL22987510 0.86 NR1H2 (0.50) NR1H2NR1H3ADORA3ADORA2AADORA1
SCHEMBL22987660 0.83 POLB (0.48) ADORA3ADORA2AADORA1
SCHEMBL22987508 0.83 AHR (0.38) PDPK1ADORA3EGLN2ADORA2AADORA1
SCHEMBL22987505 0.80 NR1H2 (0.41) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL22987675 0.78 EGFR (0.38) NR1H2NR1H3ADORA3ADORA2A
SCHEMBL29646424 0.78 ADORA3 (0.38) NR1H2NR1H3ADORA3ADORA2AADORA1
SCHEMBL22978982 0.78 ADORA3 (0.38) NR1H2NR1H3ADORA3ADORA2AADORA1
SCHEMBL22987611 0.78 ADORA3 (0.38) NR1H2NR1H3ADORA3ADORA2AADORA1
SCHEMBL22987578 0.78 ADORA3 (0.53) ADORA3ADORA2AADORA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 PDPK1 1415/4885NR1H2 296/4885NR1H3 422/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.